2-Amino-5-hydroxybenzoic Acid - CAS 394-31-0

Catalog:	BB023978
Product Name:	2-Amino-5-hydroxybenzoic Acid
CAS:	394-31-0
Synonyms:	2-amino-5-hydroxybenzoic acid; 2-amino-5-hydroxybenzoic acid

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Computed Properties

IUPAC Name:	2-amino-5-hydroxybenzoic acid
Description:	2-Amino-5-hydroxybenzoic Acid (CAS# 394-31-0) is a selective mAChR M2 antagonist.
Molecular Weight:	153.14
Molecular Formula:	C7H7NO3
Canonical SMILES:	C1=CC(=C(C=C1O)C(=O)O)N
InChI:	InChI=1S/C7H7NO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,8H2,(H,10,11)
InChI Key:	HYNQTSZBTIOFKH-UHFFFAOYSA-N
Boiling Point:	417.8 °C at 760 mmHg
Density:	1.491 g/cm³
MDL:	MFCD00007870
LogP:	1.25380

Publication Number	Title	Priority Date
WO-2021211784-A2	Method of treating coronavirus infections	20200415
WO-2021191431-A1	A consumable product comprising malted cereals for promoting recovery at physical activity	20200326
CN-111484727-A	Wide-pH-range underwater self-repairing topological interlocking network and preparation method and application thereof	20200313
CN-111484727-B	Wide-pH-range underwater self-repairing topological interlocking network and preparation method and application thereof	20200313
WO-2021175451-A1	Cosmetic or pharmaceutical use of avenanthramide l	20200306

PMID	Publication Date	Title	Journal
22941480	20120801	Inhibition of PCAF histone acetyltransferase and cytotoxic effect of N-acylanthranilic acids	Archives of pharmacal research
21687761	20110101	The involvement of neuroinflammation and kynurenine pathway in Parkinson's disease	Parkinson's disease
19339256	20090501	Kynurenine pathway inhibition reduces central nervous system inflammation in a model of human African trypanosomiasis	Brain : a journal of neurology
19384564	20090501	5-Hydroxyanthranilic acid, a tryptophan metabolite, generates oxidative stress and neuronal death via p38 activation in cultured cerebellar granule neurones	Neurotoxicity research
19071805	20070731	Sequential-injection on-line preconcentration using chitosan resin functionalized with 2-amino-5-hydroxy benzoic acid for the determination of trace elements in environmental water samples by inductively coupled plasma-atomic emission spectrometry	Talanta

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GHS Hazard Statement:	H302 (85.11%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.042593085
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	153.042593085
Rotatable Bond Count:	1
Topological Polar Surface Area:	83.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6